新型2-(2-氨基噻唑-4-基)-2-(Z)-甲氧亚胺基乙酸酯类衍生物的合成及其抑菌活性

以乙酰乙酸甲(乙)酯,醛和酰氯为主要原料,合成了8个2-(2-氨基噻唑-4-基)-2-(Z)-甲氧亚胺基乙酸酯类衍生物(其中6个未见文献报道),其结构经1H NMR,IR和MS表征.初步抑菌活性测试结果表明,在给药量为200 mg·L-1时,化合物对小麦赤霉病菌和马铃薯干腐病菌有较好的抑菌活性.     

β-咔啉肟酯类化合物的合成及其抑菌活性

以L-色氨酸和取代苯甲醛为原料,经Pictet- Spengle环合、甲酯氧化脱氢、水解及酰氯化等反应合成了1-取代-β-咔啉-3-酰氯(3a,3d,3g);3a,3d和3g分别与香草醛肟、对硝基苯甲醛肟及3,4,5-三甲氧基苯甲醛肟反应,合成了9个新型的β-咔啉肟酯类化合物(5a～5i),其结构经1H NMR和IR表...     

有机硼酸锂盐及亚硫酸酯类功能电解质材料

随着锂离子电池对高安全性、高容量、高功率等性能的技术需求,新型功能电解质材料的研究开发成为锂离子电池新材料领域研发工作的重点.本文对面向锂离子电池应用的功能电解质材料锂盐和添加剂的最新研究进展作了较为全面的阐述,其中重点介绍了本研究团队近年来在面向改善锂离子电池安全性能、提高其温度适应性、增强电解质与电极材料相容特性等...     

非异氰酸酯聚氨酯的合成与应用

聚氨酯是一种重要的高分子材料,但其关键原料异氰酸酯有毒和湿敏的缺点限制了其应用前景.环碳酸酯化合物与伯胺反应是制备得到聚氨酯的一条新途径,用这种方法合成的非异氰酸酯聚氨酯(NIPU),其羟基氨基甲酸酯基形成分子内氢键而具有比传统聚氨酯更好的耐水解性和机械性能.本文介绍了NIPU的合成机理,总结了环碳酸酯的合成方法,综述...     

食品塑料包装材料中邻苯二甲酸二烯丙酯的测定

建立了用正己烷超声提取食品塑料包装材料中的邻苯二甲酸二烯丙酯,经滤纸过滤,浓缩定容后采用选择离子模式对其进行气相色谱-质谱联机分析,外标法定量.方法对食品塑料包装材料中的邻苯二甲酸二烯丙酯的检测限为10.0μg/kg,检测浓度范围为10～500μg/L,样品的加标回收率为80％～110％,可满足食品塑料包装材料中邻苯二...     

苯甲酸-Fenton体系荧光法测定中草药抗氧化活性

利用Feton体系产生羟自由基,能与苯甲酸反应生成具有强荧光的产物,加入抗氧化剂可有效清除羟自由基,导致体系荧光强度降低.据此建立了筛选抗氧化剂的荧光新体系.应用所建立的方法测定了葛根、吴茱萸和黄连三种常见中草药的抗氧化活性.结果表明,当中草药的浓度为0.4 mg(dry weight)/mL时,葛根、吴茱萸、黄连对羟...     

1D Lanthanide Coordination Polymers Based on 3-（Pyridin-4,yl）benzoic Acid： Syntheses, Structures and Luminescent Properties

Four novel 1D lanthanide coordination polymers with formula [Ln(3,4-pybz)3(H2O)2· H2O]n (Ln = 1 Sm; 2 Eu; 3 Tb; 4 Dy, 3,4-Hpybz = 3-(pyridin-4-yl)benzoic acid) have been synthesized by hydrothermal reactions of lanthanide oxide and 3-(pyridine-4-yl) benzoic acid. Single-crystal X-ray diffraction shows that the four compounds are isostructural. They all crystallize in a monoclinic system, space group P1. They have a doubly carboxylate-bridged infinite-chain structure with alternating Ln-(carboxylate)2-Ln linkages and one chelating carboxylate group on each metal center. The Ln ion also combines to two water molecules to form an eight-coordinate square antiprismatic geometry. The pyridine nitrogen atoms of the ligand do not coordinate to the metal centers but direct the formation of a 3D network through hydrogen bonding with coordinated water molecules. The photoluminescent properties of 2 and 3 have been also studied.     

A New Series of Charge-assisted Hydrogen-bonded Host Frameworks Based on [Co（en）_3]~（3＋）and Dicarboxylates

A new series of metal complex carboxylates(MCC)made of [Co(en)3]3+(MC)and either 2,6-naphthalenedicarboxylic(NDC)or 4,4-biphenyldicarboxylic(BPDC)were synthesized and structurally characterized.The four new compounds have a general formula(MC)2(C)3·n(guest)with the guests of dimethylformamide(DMF)and dimethyl sulfoxide(DMSO)and water.All the structures represent a pillared-layer type,where the layer consists of MC cations,carboxylate anions or water molecules via a large number of hydrogen bonds.The layers are pillared by the organic residues of NDC or BPDC,resulting in the inclusion cavities where the guest molecules reside.Although their topological structures are similar,they crystallize in different crystal structures due to the rearrangement of pillars and hydrogen-bonded layers.     

Thermodynamic Properties and Relative Stability of Polyhydroxylated Dibenzo-p dioxins Calculated by Density Functional Theory

In this work, partial thermodynamic properties of polyhydroxylated dibenzo-p-dioxins (PHODDs) are calculated by density functional theory (DFT) with the Gaussian 03 program at the B3LYP/6-311G** level. By comparing the total energy Eθ values, it is found that two types of hydrogen bonds exist in PHODDs, one between a hydroxyl and the parent compound (dibenzop-dioxin) with bond energy of approximate 15.7 kJ/mol and the other between two ortho hydroxyl groups with higher bond energy of about 18.3 kJ/mol. Hydrogen bonds have an effect on the conformation stability. On the basis of evaluating the strength of these two types of hydrogen bonds, 75 most stable congeners are ascertained. The relations of calculated thermodynamic parameters (total energy Eθ, zero-point vibrational energy ZPE, correction value of thermal energy Ethθ, heat capacity at constant volume CVθ) with the number and position of hydroxyl substitution (NPHOS) are also discussed. The results show that the NPHOS models can be used to predict the thermodynamic properties for PHODD congeners. In addition, the values of molar heat capacities at constant pressure (Cp,m) from 200 to 1000 K for PHODD congeners are calculated, and the temperature dependence relation of Cp,m is obtained with the least-squares method.     

Hydrothermal Synthesis and Crystal Structure of a 2D Zinc（Ⅱ） Coordination Polymer with 5-Hydroxynicotinic Acid

The title compound,[Zn(5-hydroxynicotinate) 2 2H 2 O] n,has been synthesized by reacting zinc sulfate vitriol with 5-hydroxynicotinic acid under hydrothermal conditions,and its structure was determined by X-ray crystallography with the following data:monoclinic,space group C2/c,C 12 H 12 N 2 O 8 Zn,M r=377.61,a=10.223(3),b=10.319(3),c=13.613(4),β=105.922(6)°,Z=4,V=1380.9(8)3,F(000)=768,D c=1.816 g/cm 3,μ(MoKα)=1.826 mm-1,the final R=0.0401 and wR=0.1380 for 1157 observed reflections (I > 2σ(I)).In the structure of the title compound,the Zn II ion located in an inversion center lies in a distorted tetrahedral environment at a N 2 O 2 coordination mode,and the 5-hydroxynicotinic acid ligand links symmetry-related Zn II ions at a μ 2-N,O bridging way forming a two-dimensional covalent structure.In the crystal,solvent water molecules form intermolecular O-H O hydrogen bonds and pyridine rings of adjacent layers form π-π stacking (3.346),which connect adjacent two-dimensional sheets into a three-dimensional supramolecular network.